SCHEMBL6565392

SCHEMBL6565392

Cc1cc(C(=O)N(C)c2ccccc2)c(CC(=O)O)cc1C#CCNc1ccc(C(=N)N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.44
SIRT2 Q8IXJ6 1/20 0.38
F2 P00734 8/20 0.37
ITGB3 P05106 4/20 0.36
ITGA2B P08514 4/20 0.36
HTT P42858 1/20 0.36
F10 P00742 2/20 0.35
PLG P00747 2/20 0.35
PLAT P00750 2/20 0.35
KLK1 P06870 1/20 0.35
KLK5 Q9Y337 1/20 0.35
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
KLKB1 P03952 1/20 0.34
SLC22A2 O15244 1/20 0.34
PROC P04070 1/20 0.34
HPN P05981 1/20 0.34
PRSS1 P07477 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6565956 0.91 PLAU (0.49) PLAUSIRT2F2ITGB3ITGA2B
SCHEMBL6565486 0.91 PLAU (0.41) PLAUSIRT2F2ITGB3ITGA2B
SCHEMBL6563250 0.85 PLAU (0.54) PLAUSIRT2F2ITGB3ITGA2B
SCHEMBL6565690 0.85 PLAU (0.54) PLAUSIRT2F2ITGB3ITGA2B
SCHEMBL7672248 0.79 F2 (0.40) PLAUF2F10PLGPLAT
SCHEMBL6561967 0.78 F2 (0.42) PLAUF2F10PLGPLAT
SCHEMBL6561886 0.78 PLAU (0.53) PLAUSIRT2F2ITGB3ITGA2B
SCHEMBL6565367 0.78 TSHR (0.31) PLAUKMT2A
SCHEMBL6563712 0.77 PLAU (0.47) PLAUSIRT2ITGB3ITGA2B
SCHEMBL7806866 0.77 NR1I2 (0.40) SIRT2F2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140802-B1 SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES BOEHRINGER INGELHEIM PHARMA (DE) 2004-03-17 EP disclosed
US-6479524-B1 TO PROLONG THE THROMBIN TIME BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-11-12 US disclosed